Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | FYN | P06241 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PDE4A | P27815 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.43 |
| ▸ | GABRP | O00591 | 1/20 | 0.43 |
| ▸ | GABRD | O14764 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7118694 | 1.00 | FFAR3 (0.54) | FFAR3LCKFYNHIF1AMAPT | |
| Piperazine SCHEMBL1083046 | 1.00 | FFAR3 (0.54) | FFAR3LCKFYNHIF1AMAPT | |
| Acetic Acid SCHEMBL9599616 | 1.00 | FFAR3 (0.54) | FFAR3LCKFYNHIF1AMAPT | |
| Piperazine SCHEMBL7327328 | 1.00 | FFAR3 (0.54) | FFAR3LCKFYNHIF1AMAPT | |
| Acetic Acid SCHEMBL3451040 | 1.00 | FFAR3 (0.54) | FFAR3LCKFYNHIF1AMAPT | |
| Piperazine SCHEMBL23356456 | 0.96 | FFAR3 (0.50) | FFAR3LCKFYNHIF1AMAPT | |
| Piperazine SCHEMBL27374005 | 0.96 | FFAR3 (0.50) | FFAR3LCKFYNHIF1AMAPT | |
| Piperazine SCHEMBL28060598 | 0.96 | FFAR3 (0.50) | FFAR3LCKFYNHIF1AMAPT | |
| Piperazine SCHEMBL28060534 | 0.96 | FFAR3 (0.50) | FFAR3LCKFYNHIF1AMAPT | |
| Piperazine SCHEMBL9717041 | 0.96 | FFAR3 (0.50) | FFAR3LCKFYNHIF1AMAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11043702-B2 | Zinc ion secondary battery including aqueous electrolyte | INDUSTRY-ACADEMIA COOPERATION GROUP OF SEJONG UNIVERSITY (KR) | 2021-06-22 | — | — | US | claimed |
| US-20200099105-A1 | ZINC ION SECONDARY BATTERY INCLUDING AQUEOUS ELECTROLYTE | INDUSTRY-ACADEMIA COOPERATION GROUP OF SEJONG UNIVERSITY (KR) | 2020-03-26 | — | — | US | claimed |
| EP-3627611-A1 | ZINC SALTS WHICH CAN BE USED AS LIQUID ELECTROLYTE OF ZINC-ION BATTERY | Industry-Academia Cooperation Group of Sejong University (KR) | 2020-03-25 | — | — | EP | claimed |
| WO-2001052899-A1 | CHELATING AGENTS AND METHOD FOR THEIR USE AS TANDEM METAL CHELATORS AND HYDROPHILIC SPACERS FOR MEDICAL DIAGNOSIS AND THERAPY | MALLINCKRODT INC. (US) | 2001-07-26 | — | — | WO | claimed |
| US-11043702-B2 | Zinc ion secondary battery including aqueous electrolyte | INDUSTRY-ACADEMIA COOPERATION GROUP OF SEJONG UNIVERSITY (KR) | 2021-06-22 | — | — | US | disclosed |
| US-20200099105-A1 | ZINC ION SECONDARY BATTERY INCLUDING AQUEOUS ELECTROLYTE | INDUSTRY-ACADEMIA COOPERATION GROUP OF SEJONG UNIVERSITY (KR) | 2020-03-26 | — | — | US | disclosed |
| EP-3627611-A1 | ZINC SALTS WHICH CAN BE USED AS LIQUID ELECTROLYTE OF ZINC-ION BATTERY | Industry-Academia Cooperation Group of Sejong University (KR) | 2020-03-25 | — | — | EP | disclosed |
| EP-1602649-B1 | Process for the preparation of monofunctionalized 1,4,7,10-tetraazacyclododecane | BRACCO SPA (IT) | 2010-08-18 | — | — | EP | disclosed |
| WO-2001052898-A9 | METHODS FOR INCORPORATING METAL CHELATORS AT CARBOXYL-TERMINAL SITE OF PEPTIDES | MALLINCKRODT INC (US) | 2002-10-31 | — | — | WO | disclosed |
| WO-2001052898-A1 | METHODS FOR INCORPORATING METAL CHELATORS AT CARBOXYL-TERMINAL SITE OF PEPTIDES | MALLINCKRODT INC. (US) | 2001-07-26 | — | — | WO | disclosed |
| WO-2001052900-A2 | NOVEL ORTHOGONALLY PROTECTED AMINO ACID CHELATORS FOR BIOMEDICAL APPLICATIONS | MALLINCKRODT INC. (US) | 2001-07-26 | — | — | WO | disclosed |